COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.369  -5.287   1.023  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.560  -4.211   1.311  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.638  -3.057   0.534  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.548  -3.014  -0.539  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.358  -4.117  -0.813  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.265  -5.237  -0.036  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.976  -1.853   0.577  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.420  -1.029  -0.424  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.400  -1.686  -1.150  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.936   0.337  -0.682  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.473   1.379  -0.017  1.00  0.00           N  
HETATM   12  C   UNL     1      -2.072   2.748  -0.353  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.801   3.114   0.421  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.454   4.580   0.153  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.545   5.442   0.622  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.717   5.154  -0.210  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.189   3.720   0.037  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.146   6.825   0.327  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.276   7.777   0.726  1.00  0.00           C  
HETATM   20  C   UNL     1       0.116   7.172   1.119  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.944  -1.501   1.555  1.00  0.00           C  
HETATM   22  C   UNL     1       0.409  -1.895   1.021  1.00  0.00           C  
HETATM   23  N   UNL     1       0.771  -3.080   0.615  1.00  0.00           N  
HETATM   24  O   UNL     1       1.919  -3.098   0.235  1.00  0.00           O  
HETATM   25  C   UNL     1       2.494  -1.886   0.353  1.00  0.00           C  
HETATM   26  C   UNL     1       1.530  -1.057   0.871  1.00  0.00           C  
HETATM   27  C   UNL     1       3.874  -1.525  -0.001  1.00  0.00           C  
HETATM   28  S   UNL     1       4.692   0.056   0.131  1.00  0.00           S  
HETATM   29  C   UNL     1       6.288  -0.429  -0.505  1.00  0.00           C  
HETATM   30  C   UNL     1       6.102  -1.750  -0.775  1.00  0.00           C  
HETATM   31  C   UNL     1       4.878  -2.323  -0.518  1.00  0.00           C  
HETATM   32 CL   UNL     1       7.714   0.536  -0.722  1.00  0.00          Cl  
HETATM   33  O   UNL     1      -1.052   0.526  -1.496  1.00  0.00           O  
HETATM   34  C   UNL     1      -4.124  -1.173  -2.275  1.00  0.00           C  
HETATM   35  N   UNL     1      -4.698  -0.766  -3.167  1.00  0.00           N  
HETATM   36  C   UNL     1      -1.594  -4.280   2.465  1.00  0.00           C  
HETATM   37  H   UNL     1      -3.306  -6.180   1.628  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.057  -4.085  -1.636  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.892  -6.090  -0.249  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.125   1.223   0.684  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.881   2.822  -1.423  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.970   2.969   1.488  1.00  0.00           H  
HETATM   43  H   UNL     1       0.021   2.479   0.092  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.310   4.729  -0.917  1.00  0.00           H  
HETATM   45  H   UNL     1       0.464   4.838   0.681  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.520   5.848   0.041  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.454   5.273  -1.261  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.430   3.593   1.093  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.074   3.519  -0.566  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.946   6.926  -0.739  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.981   8.803   0.507  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.175   7.530   0.162  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.477   7.676   1.792  1.00  0.00           H  
HETATM   54  H   UNL     1       0.336   8.233   1.005  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.042   6.944   2.173  1.00  0.00           H  
HETATM   56  H   UNL     1       0.954   6.585   0.742  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.965  -0.426   1.735  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.133  -2.029   2.490  1.00  0.00           H  
HETATM   59  H   UNL     1       1.612  -0.006   1.107  1.00  0.00           H  
HETATM   60  H   UNL     1       6.907  -2.342  -1.184  1.00  0.00           H  
HETATM   61  H   UNL     1       4.704  -3.368  -0.723  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.048  -3.829   3.347  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.351  -5.322   2.674  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.683  -3.739   2.209  1.00  0.00           H  
CONECT    1    2    2    6   37                                       
CONECT    2    1    1    3   36                                       
CONECT    3    2    4    4    7                                       
CONECT    4    3    3    5    9                                       
CONECT    5    4    6    6   38                                       
CONECT    6    1    5    5   39                                       
CONECT    7    3    8   21                                            
CONECT    8    7    9    9   10                                       
CONECT    9    4    8    8   34                                       
CONECT   10    8   11   33   33                                       
CONECT   11   10   12   40                                            
CONECT   12   11   13   17   41                                       
CONECT   13   12   14   42   43                                       
CONECT   14   13   15   44   45                                       
CONECT   15   14   16   18                                            
CONECT   16   15   17   46   47                                       
CONECT   17   12   16   48   49                                       
CONECT   18   15   19   20   50                                       
CONECT   19   18   51   52   53                                       
CONECT   20   18   54   55   56                                       
CONECT   21    7   22   57   58                                       
CONECT   22   21   23   23   26                                       
CONECT   23   22   22   24                                            
CONECT   24   23   25                                                 
CONECT   25   24   26   26   27                                       
CONECT   26   22   25   25   59                                       
CONECT   27   25   28   31   31                                       
CONECT   28   27   29                                                 
CONECT   29   28   30   30   32                                       
CONECT   30   29   29   31   60                                       
CONECT   31   27   27   30   61                                       
CONECT   32   29                                                      
CONECT   33   10   10                                                 
CONECT   34    9   35   35   35                                       
CONECT   35   34   34   34                                            
CONECT   36    2   62   63   64                                       
CONECT   37    1                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   26                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   36                                                      
CONECT   63   36                                                      
CONECT   64   36                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
